ChalcoDB: An Open-Source Informatics Platform for Data-Driven Design of I--II--IV--VI and I--III--VI Semiconductors
Abstract
ChalcoDB unifies high-throughput DFT, machine learning, and ML force fields into an open platform for rapid, data-driven design of multinary chalcogenide semiconductors.
Fields of Study & Subjects
Machine Learning in Materials Science
Advanced Chemical Physics Studies
Crystal Structures and Properties
Publication details
- Journal / source
- HubZero
- Publication date
- 1 January 2026
- Language
- EN